Development of the CHARMM Force Field for Lipids von Pastor, R. W, MacKerell, A. D

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Nonadditive Compositional Curvature Energetics of Lipid Bilayers von Sodt, A J, Venable, R M, Lyman, E, Pastor, R W

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CHARMM: The biomolecular simulation program von Brooks, B.R, Brooks, C.L. III, Mackerell, A.D. Jr, Nilsson, L, Petrella, R.J, Roux, B, Won, Y, Archontis, G, Bartels, C, Boresch, S, Caflisch, A, Caves, L, Cui, Q, Dinner, A.R, Feig, M, Fischer, S, Gao, J, Hodoscek, M, Im, W, Kuczera, K, Lazaridis, T, Ma, J, Ovchinnikov, V, Paci, E, Pastor, R.W, Post, C.B, Pu, J.Z, Schaefer, M, Tidor, B, Venable, R.M, Woodcock, H.L, Wu, X, Yang, W, York, D.M, Karplus, M

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Langevin dynamics of peptides: The frictional dependence of isomerization rates of N-acetylalanyl-N′-methylamide von Loncharich, Richard J., Brooks, Bernard R., Pastor, Richard W.

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Molecular Dynamics Simulations of a Lipid Bilayer and of Hexadecane: An Investigation of Membrane Fluidity von Venable, Richard M., Zhang, Yuhong, Hardy, Barry J., Pastor, Richard W.

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Molecular dynamics studies of the conformation of sorbitol von Lerbret, A., Mason, P.E., Venable, R.M., Cesàro, A., Saboungi, M.-L., Pastor, R.W., Brady, J.W.

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Molecular Dynamics Simulations of the Influenza Hemagglutinin Fusion Peptide in Micelles and Bilayers: Conformational Analysis of Peptide and Lipids von Lagüe, Patrick, Roux, Benoît, Pastor, Richard W.

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Molecular dynamics simulation of unsaturated lipid bilayers at low hydration: parameterization and comparison with diffraction studies von Feller, S.E., Yin, D., Pastor, R.W., MacKerell, A.D.

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The stability of house dust mite allergens in glycerinated extracts von Soldatova, Lyudmila N., Paupore, Elizabeth J., Burk, Suzann H., Pastor, Richard W., Slater, Jay E.

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The determination of equivalent doses of standardized allergen vaccines von Slater, Jay E., Pastor, Richard W.

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Computer Simulation of a DPPC Phospholipid Bilayer:  Structural Changes as a Function of Molecular Surface Area von Feller, Scott E, Venable, Richard M, Pastor, Richard W

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Model for the Structure of the Lipid Bilayer von Pastor, Richard W., Venable, Richard M., Karplus, Martin

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On simulating lipid bilayers with an applied surface tension: periodic boundary conditions and undulations von Feller, S.E., Pastor, R.W.

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Frictional models for stochastic simulations of proteins von Venable, Richard M., Pastor, Richard W.

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A Recognition Site on Synthetic Helical Oligonucleotides for Monoclonal Anti-Native DNA Autoantibody von Stollar, B. David, Zon, Gerald, Pastor, Richard W.

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Mean field stochastic boundary molecular dynamics simulation of a phospholipid in a membrane von De Loof, Hans, Harvey, Stephen C, Segrest, Jere P, Pastor, Richard W

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Solution structure and dynamics of linked cell attachment modules of mouse fibronectin containing the RGD and synergy regions: comparison with the human fibronectin crystal structu... von Copié, V, Tomita, Y, Akiyama, S K, Aota, S, Yamada, K M, Venable, R M, Pastor, R W, Krueger, S, Torchia, D A

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An analysis of the accuracy of Langevin and molecular dynamics algorithms von Pastor, Richard W., Brooks, Bernard R., Szabo, Attila

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Importance of the CMAP Correction to the CHARMM22 Protein Force Field: Dynamics of Hen Lysozyme von Buck, Matthias, Bouguet-Bonnet, Sabine, Pastor, Richard W., MacKerell, Alexander D.

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Application of NMR, molecular simulation, and hydrodynamics to conformational analysis of trisaccharides von Dixon, Ann M., Venable, Richard, Widmalm, Göran, Bull, T.E., Pastor, Richard W.

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